Benzylboronic acid

• Catalog Number: ACM4463427
• Product Name: Benzylboronic acid
• CAS: 4463-42-7
• Category: Boronic Acids
• IUPAC Name: benzylboronic acid
• Molecular Weight: 135.96g/mol
• Molecular Formula: C7H9BO2
• Canonical SMILES: B(CC1=CC=CC=C1)(O)O
• InChI: InChI=1S/C7H9BO2/c9-8(10)6-7-4-2-1-3-5-7/h1-5,9-10H,6H2
• InChI Key: HBWDWGMBZIFBQE-UHFFFAOYSA-N
• Complexity: 89.6
• Covalently-Bonded Unit Count: 1
• Exact Mass: 136.06956g/mol
• Formal Charge: 0
• H-Bond Acceptor: 2
• H-Bond Donor: 2
• Heavy Atom Count: 10
• Monoisotopic Mass: 136.06956g/mol
• Rotatable Bond Count: 2